Mrv1652309122216232D 30 33 0 0 1 0 999 V2000 7.1358 -0.3805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1358 -1.2055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4214 -1.6180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7069 -1.2055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7069 -0.3805 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9924 -1.6180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9924 -2.4430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2780 -1.2055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5243 -1.5411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9722 -0.9280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3847 -0.2135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1298 0.5711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3228 0.7427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0679 1.5273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6199 2.1404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3650 2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9170 3.5381 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6621 4.3227 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7240 3.3666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9789 2.5819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4269 1.9688 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2339 1.7973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6818 1.1842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4888 1.0127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7437 0.2281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1917 -0.3850 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9763 -0.6400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8503 -1.6180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5648 -1.2055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8503 -2.4430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 1 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 15 21 1 0 0 0 0 21 22 1 1 0 0 0 21 23 1 0 0 0 0 12 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 8 26 1 0 0 0 0 11 26 1 0 0 0 0 26 27 1 1 0 0 0 2 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 M END > NP0329730 > NP-MRD > CC(C)C(=C)CC(O)C(C)C1CCC2C3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@]12C > InChI=1S/C28H46O2/c1-17(2)18(3)15-26(30)19(4)23-9-10-24-22-8-7-20-16-21(29)11-13-27(20,5)25(22)12-14-28(23,24)6/h7,17,19,21-26,29-30H,3,8-16H2,1-2,4-6H3/t19?,21-,22?,23?,24?,25?,26?,27-,28+/m0/s1 > ABTDMVGTVHLKEM-LVVCFWQASA-N > C28H46O2 > 414.674 > 414.349780721 > 2 > 76 > 51.524066949413026 > 1 > 2 > 0 > 0 > (2R,5S,15S)-14-(3-hydroxy-6-methyl-5-methylideneheptan-2-yl)-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-7-en-5-ol > 5.743497519 > 0 > 4 > 0 > 19.719003825173235 > 18.20428950550382 > -0.649237918190582 > 40.46 > 126.53509999999997 > 5 > 0 > (2R,5S,15S)-14-(3-hydroxy-6-methyl-5-methylideneheptan-2-yl)-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-7-en-5-ol > 0 > NP0329730 > 2-[(7s,9ar,11as)-7-hydroxy-9a,11a-dimethyl-1h,2h,3h,3ah,3bh,4h,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]-6-methyl-5-methylideneheptan-3-ol $$$$